BindingDB logo
myBDB logout

null

SMILES: Cl.Cl.[H][C@]12CN(CCN3CCOCC3)C(=N)N1Cc1ccccc1C2

InChI Key: InChIKey=CUXMSSIXVYHDPY-SQKCAUCHSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50499699   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50499699
PNG
(CHEMBL3740794)
Show SMILES Cl.Cl.[H][C@]12CN(CCN3CCOCC3)C(=N)N1Cc1ccccc1C2 |r|
Show InChI InChI=1S/C17H24N4O.2ClH/c18-17-20(6-5-19-7-9-22-10-8-19)13-16-11-14-3-1-2-4-15(14)12-21(16)17;;/h1-4,16,18H,5-13H2;2*1H/t16-;;/m0../s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ de Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-ZM24135 from human adenosine A2A receptor expressed in HEK293 cells after 1 hr by scintillation counting


Eur J Med Chem 106: 15-25 (2015)


Article DOI: 10.1016/j.ejmech.2015.10.030
BindingDB Entry DOI: 10.7270/Q2K64N3P
More data for this
Ligand-Target Pair